[4-(3-bromophenyl)sulfonylpiperazin-1-yl]-(2,4,5-trimethoxyphenyl)methanone

Systemtic Name: [4-(3-bromophenyl)sulfonylpiperazin-1-yl]-(2,4,5-trimethoxyphenyl)methanone Openeye Name: [4-(3-bromophenyl)sulfonylpiperazin-1-yl]-(2,4,5-trimethoxyphenyl)methanone CAS Name: [4-(3-bromophenyl)sulfonyl-1-piperazinyl]-(2,4,5-trimethoxyphenyl)methanone IUPAC Name: [4-(3-bromophenyl)sulfonylpiperazin-1-yl]-(2,4,5-trimethoxyphenyl)methanone Traditional Name: asaryl-[4-(3-bromophenyl)sulfonylpiperazino]methanone Formula: C20H23BrN2O6S MolecularWeight: 499.37542

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Br)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Br)OC)OC

InChI

InChI=1S/C20H23BrN2O6S/c1-27-17-13-19(29-3)18(28-2)12-16(17)20(24)22-7-9-23(10-8-22)30(25,26)15-6-4-5-14(21)11-15/h4-6,11-13H,7-10H2,1-3H3